Lumisterol

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Formula C28H44O
IUPAC Name (3s,9r,10s,13r,14r,17r)-10,13-dimethyl-17-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-2,3,4,9,11,12,14,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-3-ol
Molecular Mass 396.648 g·mol−1
Heat of Formation -373.9 ± 16.7 kJ·mol−1
Dipole Moment 2.66 ± 1.08 D
Volume 552.18 Å 3
Surface Area 430.02 Å 2
HOMO Energy -8.45 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,9r,10s,13r,14r,17r)-10,13-dimethyl-17-[(e,1r,4r)-1,4,5-trimethylhex-2-enyl]-2,3,4,9,11,12,14,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-3-ol
  • (3s,9r,10s,13r,14r,17r)-17-[(e,2r,5r)-5,6-dimethylhept-3-en-2-yl]-10,13-dimethyl-2,3,4,9,11,12,14,15,16,17-decahydro-1h-cyclopenta[a]phenanthren-3-ol
  • 9-beta,10-alpha-ergosta-5,7,22-trien-3-beta-ol
CAS Number(s)
  • 474-69-1
InChIKey DNVPQKQSNYMLRS-YAPGYIAOSA-N
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